CHEMBL5410873
| SMILES | CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H]1Cn2nncc2CNC1=O |
| InChIKey | KSNMTKCFCCBKIQ-KIHHCIJBSA-N |
Chemical properties
| Hydrogen bond acceptors | 10 |
| Hydrogen bond donors | 9 |
| Rotatable bonds | 15 |
| Molecular weight (Da) | 649.3 |
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| MC1 | MSHR | Human | Melanocortin | A | pIC50 | 8.02 | 8.02 | 8.02 | ChEMBL |
| MC1 | MSHR | Human | Melanocortin | A | pEC50 | 6.87 | 6.87 | 6.87 | ChEMBL |